1,2-Tetradecanediol

C14H30O2CAS 21129-09-9230.39 g/mol

Open in Covalent MOL file
OHOH
Alcohol

Properties

Molecular formula
C14H30O2
Molar mass
230.39 g/mol
Exact mass
230.2246 Da
Melting point
68–68.5 °C
Boiling point
152–154 °C (at 0.2 Torr)
logP
3.65Crippen estimate
Polar surface area
40.5 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
12

Hazards

Not classified as hazardous under GHS by 24 ECHA notifiers. Aggregated from 24 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Identifiers

CAS number
21129-09-9
SMILES
CCCCCCCCCCCCC(O)CO
InChIKey
DWANEFRJKWXRSG-UHFFFAOYSA-N
InChI
InChI=1S/C14H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-14(16)13-15/h14-16H,2-13H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

4 names
  • 1,2-Tetradecylene glycol
  • n-Tetradecane-1,2-diol
  • NSC 71507
  • 1,2-Dihydroxytetradecane

Work with 1,2-Tetradecanediol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,2-Octanediol1117-86-8100 % similar 1,2-Decanediol1119-86-4100 % similar 1,2-Dodecanediol1119-87-5100 % similar 1,2-Hexadecanediol6920-24-7100 % similar 1,2-Hexanediol6920-22-583 % similar 6-Undecanol23708-56-770 % similar Decan-4-ol2051-31-268 % similar 1,2-Pentanediol5343-92-067 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1,14-Tetradecanediol19812-64-7 1,1′-[Ethylidenebis(oxy)]bis[hexane]5405-58-3 Polyethylene glycol lauryl ether6540-99-4 Polyethylene glycol lauryl ether9002-92-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook